>> Thanks,
>> Jamie
>>
>>> On Dec 2, 2022, at 10:56 AM, Iurii TIMROV >> <mailto:iurii.tim...@epfl.ch>> wrote:
>>>
>>> Thanks! Could you upload please also the input and output files of the pw.x
>>> calculations?
>>&
//people.epfl.ch/265334
From: Jamie Holber
Sent: Friday, December 2, 2022 5:58:39 PM
To: Iurii TIMROV
Cc: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Problem with Parallelization of Hp.x
Hi Iurii,
Thanks for the quick resolution!
In regards to the DFT+U+V I was f
sanne (EPFL)
> CH-1015 Lausanne, Switzerland
> +41 21 69 34 881
> http://people.epfl.ch/265334 <http://people.epfl.ch/265334>
> From: Jamie Holber
> Sent: Friday, December 2, 2022 5:04:00 PM
> To: Iurii TIMROV
> Cc: Quantum ESPRESSO users Forum
> Subject: Re: [QE-users] Probl
265334
From: Jamie Holber
Sent: Friday, December 2, 2022 5:04:00 PM
To: Iurii TIMROV
Cc: Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Problem with Parallelization of Hp.x
Just uploaded.
Thanks,
Jamie
On Dec 2, 2022, at 10:56 AM, Iurii TIMROV
mailto:iurii.tim...@epfl.ch&g
>> CH-1015 Lausanne, Switzerland
>> +41 21 69 34 881
>> http://people.epfl.ch/265334 <http://people.epfl.ch/265334>
>>
>> From: users > <mailto:users-boun...@lists.quantum-espresso.org>> on behalf of Jamie Holber
>> mailto:hol...@umich.edu&g
://people.epfl.ch/265334
From: Jamie Holber
Sent: Friday, December 2, 2022 4:45:13 PM
To: Iurii TIMROV; Quantum ESPRESSO users Forum
Subject: Re: [QE-users] Problem with Parallelization of Hp.x
Hi Iurii,
Thanks for the response. I don’t believe it is a problem
witzerland
> +41 21 69 34 881
> http://people.epfl.ch/265334 <http://people.epfl.ch/265334>
> From: users on behalf of Jamie
> Holber
> Sent: Thursday, December 1, 2022 9:03:19 PM
> To: users@lists.quantum-espresso.org
> Subject: [QE-users] Problem with Par
of Jamie
Holber
Sent: Thursday, December 1, 2022 9:03:19 PM
To: users@lists.quantum-espresso.org
Subject: [QE-users] Problem with Parallelization of Hp.x
Hello everyone,
I am trying to replicate the U+V calculations for LiMnFePo4 as described in
Timrov, Iurii, Nicola Marzari, and Matteo
Hello everyone,
I am trying to replicate the U+V calculations for LiMnFePo4 as described in
Timrov, Iurii, Nicola Marzari, and Matteo Cococcioni. "HP--A code for the
calculation of Hubbard parameters using density-functional perturbation
theory." arXiv preprint arXiv:2203.15684 (2022).
